Version2.0 2020-01-14T11:22:46Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 22-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@H](c1ccccc1)NC(=O)c2ccccc2NC(=O)COC(=O)CN3C(=O)[C@@H]4CC=CC[C@@H]4C3=O C09119885 RHF 6-31G(d) (6D,7F) C[C@@H](c1ccccc1)NC(=O)c2ccccc2NC(=O)COC(=O)CN3C(=O)[C@@H]4CC=CC[C@@H]4C3=O C01[X(C27H27N3O6)] 183 C1 594 O=C(CN1C(=O)[C@@H]2[C@H](C1=O)CC=CC2)OCC(=O)Nc1ccccc1C(=O)N[C@H](c1ccccc1)C O=C(CN1C(=O)[C@@H]2[C@H](C1=O)CC=CC2)OCC(=O)Nc1ccccc1C(=O)N[C@H](c1ccccc1)C C[C@H](NC(=O)c1ccccc1NC(=O)COC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c4ccccc4 InChIKey=LLBCFPXKTRDXCB-YSIASYRMSA-N InChI=1S/C27H27N3O6/c1-17(18-9-3-2-4-10-18)28-25(33)21-13-7-8-14-22(21)29-23(31)16-36-24(32)15-30-26(34)19-11-5-6-12-20(19)27(30)35/h2-10,13-14,17,19-20H,11-12,15-16H2,1H3,(H,28,33)(H,29,31)/t17-,19-,20+/m0/s1 InChI=1/C27H27N3O6/c1-17(18-9-3-2-4-10-18)28-25(33)21-13-7-8-14-22(21)29-23(31)16-36-24(32)15-30-26(34)19-11-5-6-12-20(19)27(30)35/h2-10,13-14,17,19-20H,11-12,15-16H2,1H3,(H,28,33)(H,29,31)/t17-,19-,20+/m0/s1/f/h28-29H C[C@@H](c1ccccc1)NC(=O)c2ccccc2NC(=O)COC(=O)CN3C(=O)[C@@H]4CC=CC[C@@H]4C3=O C01[X(C27H27N3O6)] 183 C01 594 O=C(CN1C(=O)[C@@H]2[C@H](C1=O)CC=CC2)OCC(=O)Nc1ccccc1C(=O)N[C@H](c1ccccc1)C O=C(CN1C(=O)[C@@H]2[C@H](C1=O)CC=CC2)OCC(=O)Nc1ccccc1C(=O)N[C@H](c1ccccc1)C C[C@H](NC(=O)c1ccccc1NC(=O)COC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c4ccccc4 InChIKey=LLBCFPXKTRDXCB-YSIASYRMSA-N InChI=1S/C27H27N3O6/c1-17(18-9-3-2-4-10-18)28-25(33)21-13-7-8-14-22(21)29-23(31)16-36-24(32)15-30-26(34)19-11-5-6-12-20(19)27(30)35/h2-10,13-14,17,19-20H,11-12,15-16H2,1H3,(H,28,33)(H,29,31)/t17-,19-,20+/m0/s1 InChI=1/C27H27N3O6/c1-17(18-9-3-2-4-10-18)28-25(33)21-13-7-8-14-22(21)29-23(31)16-36-24(32)15-30-26(34)19-11-5-6-12-20(19)27(30)35/h2-10,13-14,17,19-20H,11-12,15-16H2,1H3,(H,28,33)(H,29,31)/t17-,19-,20+/m0/s1/f/h28-29H 3520.1815711765 -1650.7939746 1-A 32758.0248 129 465 594 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.62187 -20.56332 -20.55543 -20.55324 -20.54144 -20.54094 -15.61845 -15.59902 -15.59489 -11.39052 -11.36764 -11.36720 -11.36584 -11.36462 -11.30747 -11.30412 -11.28883 -11.28192 -11.25763 -11.25569 -11.25550 -11.25451 -11.25077 -11.24808 -11.24410 -11.24288 -11.24260 -11.24138 -11.24065 -11.23757 -11.23709 -11.23694 -11.23200 -11.23023 -11.22823 -11.21671 -1.49259 -1.43293 -1.41232 -1.41025 -1.40777 -1.38149 -1.28690 -1.26626 -1.25161 -1.16812 -1.15989 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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 3.0691 7.0364 14.9813 20.8041 30.4428 32.8708 41.6049 44.7056 49.8758 58.1408 68.8069 77.0282 91.8240 107.3800 107.9356 117.7170 125.5559 138.4759 158.6587 190.7555 201.7305 222.4072 235.4954 237.2144 256.6608 266.7354 289.0492 307.5927 315.1699 334.6670 348.4856 379.7901 380.9179 387.7351 402.8210 422.8560 440.8941 453.5703 455.9840 515.9519 516.8520 532.6308 549.6277 581.2054 585.0440 605.4289 619.5485 623.2872 639.3273 642.5789 659.3075 666.0299 680.7443 691.8973 728.3097 734.4623 748.1448 772.1652 779.1454 783.7924 792.6943 828.7996 834.7793 839.8537 857.5090 860.5720 868.6715 893.4215 905.3577 913.8493 930.8620 960.2805 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0.03493 0.03104 4.42 10.12 21.55 29.93 43.80 47.29 59.86 64.32 71.76 83.65 99.00 110.83 132.11 154.50 155.30 169.37 180.65 199.24 228.27 274.45 290.25 319.99 338.83 341.30 369.28 383.77 415.88 442.56 453.46 481.51 501.39 546.43 548.06 557.86 579.57 608.40 634.35 652.59 656.06 742.34 743.63 766.34 790.79 836.22 841.75 871.08 891.39 896.77 919.85 924.53 948.60 958.27 979.44 995.49 1047.88 1056.73 1076.41 1110.97 1121.02 1127.70 1140.51 1192.46 1201.06 1208.36 1233.76 1238.17 1249.82 1285.43 1302.61 1314.83 1339.30 1381.63 1404.07 1418.15 1420.02 1444.95 1480.89 1490.46 1492.67 1501.26 1556.33 1560.01 1566.47 1572.59 1588.12 1596.62 1616.40 1620.36 1624.32 1628.60 1634.22 1643.76 1655.12 1663.44 1691.53 1696.67 1717.08 1727.40 1734.96 1748.85 1753.49 1778.82 1787.14 1796.84 1836.25 1864.01 1877.95 1894.43 1902.51 1902.54 1909.51 1931.34 1933.46 1950.79 1985.96 1996.17 2021.55 2025.12 2030.90 2076.16 2078.04 2104.53 2108.35 2138.29 2174.09 2175.53 2184.64 2189.36 2210.36 2238.21 2241.02 2248.88 2268.64 2283.63 2306.94 2325.18 2333.33 2340.07 2357.23 2357.72 2363.45 2367.64 2373.17 2406.28 2439.40 2495.96 2568.11 2580.63 2604.81 2608.91 2729.02 2734.38 2863.95 2874.30 2905.53 2959.82 4599.03 4617.83 4626.49 4630.14 4672.13 4683.60 4685.87 4693.64 4725.99 4727.89 4730.27 4754.55 4761.76 4801.13 4808.13 4823.87 4831.84 4837.40 4845.79 4846.31 4860.35 4864.16 4877.43 4886.15 4986.71 5453.44 5607.74 0.547108 0.577802 0.578746 0.475801 -1650.246866 -1650.216172 -1650.215228 -1650.318173 3.452792D-04 MUNgauss RevisionA2.0 retrievium 14-Jan-2020 DUDE C[C@@H](c1ccccc1)NC(=O)c2ccccc2NC(=O)COC(=O)CN3C(=O)[C@@H]4CC=CC[C@@H]4C3=O C09119885 RHF 6-31G(d) (6D,10F) C1 489.189986 |X|Y|Z| 68.862258 163.496854 35.843799 73.898376 30 6 7 8 26 3 1 |36.858105| |12.447275|36.858105| |8.945875|17.607860|0.500000| |7.502185|12.538212|0.248972|36.858105| |5.292496|7.552987|0.206169|13.724649|36.858105| |3.996781|5.007204|0.133894|7.892869|13.735419|36.858105| |3.730671|4.416907|0.111136|6.819030|7.934303|13.768778|36.858105| |4.306131|4.996355|0.116564|7.890327|6.892847|7.958865|13.738801|36.858105| |6.079439|7.504818|0.155429|13.675964|7.970936|6.891416|7.933201|13.765198|36.858105| |7.706883|12.993693|0.256112|7.837178|5.463751|4.096789|3.817498|4.412591|6.275044|53.358707| |5.991338|7.746229|0.202714|5.176461|4.164164|3.276603|3.035062|3.366291|4.346673|19.240300|36.858105| |5.947642|6.900767|0.209071|4.552417|3.864768|3.037592|2.757345|2.975433|3.735680|11.608642|15.706696|73.516695| |4.208037|5.007591|0.130982|3.974277|3.346979|2.802085|2.674954|2.964177|3.628689|10.707433|12.687733|14.219501|36.858105| |3.853299|4.418980|0.109546|3.785895|3.137882|2.718537|2.697654|3.077982|3.725302|9.070990|7.610580|9.495130|13.672456|36.858105| |3.018860|3.358451|0.085833|3.022768|2.613225|2.342142|2.348747|2.633540|3.033874|6.153325|5.033935|7.114070|7.870052|13.816202|36.858105| |2.657836|2.949585|0.078288|2.644666|2.361622|2.123589|2.094021|2.283997|2.585432|5.182013|4.454185|6.711801|6.862933|8.011594|13.756717|36.858105| |2.755219|3.091201|0.084652|2.693943|2.435928|2.153971|2.075672|2.228190|2.542161|5.407631|5.010076|7.851669|7.891379|6.899504|7.909404|13.792970|36.858105| |3.348475|3.857152|0.107139|3.190348|2.841735|2.433686|2.302688|2.476236|2.906881|7.071016|7.514022|11.520313|13.542156|7.894215|6.801726|7.912945|13.666961|36.858105| |3.259822|3.722486|0.109602|3.035499|2.787867|2.367364|2.189948|2.303038|2.682140|6.281592|6.642207|12.518681|7.872039|5.165571|4.534560|5.149077|7.797885|13.596440|53.358707| |2.689158|3.018582|0.089862|2.567836|2.435673|2.115979|1.954640|2.020103|2.290978|4.799873|4.551576|8.667700|5.137206|3.897833|3.682072|4.352216|6.347509|7.662658|19.053311|36.858105| |2.354773|2.630047|0.076872|2.308553|2.204793|1.955190|1.826141|1.883139|2.101533|4.170408|3.770295|6.830123|4.434786|3.616821|3.625927|4.520567|6.580981|6.489789|11.386357|15.972376|73.516695| |2.616622|2.879136|0.088336|2.443582|2.363294|2.048870|1.868403|1.906263|2.150478|4.320085|3.959298|8.121476|4.006003|3.141386|2.914348|3.259910|4.256717|5.076990|10.886370|12.504038|14.175467|36.858105| |2.209017|2.415916|0.073421|2.121414|2.088561|1.850439|1.693986|1.710497|1.892428|3.562340|3.108359|6.109842|3.192123|2.638850|2.525844|2.849665|3.587518|3.933609|7.257622|8.024312|12.843279|13.558035|73.516695| |2.062923|2.219838|0.067836|1.965291|1.956082|1.744186|1.592269|1.596342|1.753397|3.180325|2.706300|5.378010|2.696171|2.276251|2.170353|2.391785|2.892897|3.159844|5.528431|5.274801|8.572600|8.186988|25.659457|36.858105| |2.152288|2.284648|0.070540|2.004362|1.996934|1.769642|1.607702|1.610582|1.775783|3.208974|2.720609|5.548573|2.627251|2.213196|2.078363|2.245325|2.678761|2.990391|5.210932|4.602171|7.150883|7.189908|15.261815|16.059173|73.516695| |1.783698|1.914902|0.057762|1.734268|1.739387|1.578569|1.451162|1.447472|1.567961|2.735878|2.273055|4.386466|2.299521|1.998850|1.943073|2.148436|2.536091|2.663680|4.396232|4.077771|7.248417|5.222279|14.559499|12.575890|14.084088|36.858105| |1.657717|1.757412|0.053011|1.602877|1.617375|1.477427|1.358459|1.349145|1.452868|2.467018|2.017318|3.904703|2.008049|1.767626|1.712211|1.862107|2.149407|2.262689|3.647636|3.197469|5.584620|3.999748|9.446348|7.809866|12.303083|13.272374|53.358707| |1.632834|1.735316|0.052689|1.597360|1.632738|1.497794|1.368290|1.346584|1.441871|2.399665|1.933544|3.739431|1.894659|1.674127|1.609614|1.727075|1.970893|2.093456|3.338707|2.838410|4.893001|3.496870|7.715715|5.922418|10.391313|7.696952|18.754446|36.858105| |1.679110|1.806917|0.055198|1.675167|1.730880|1.590116|1.442496|1.409094|1.504030|2.490048|1.992688|3.833103|1.943222|1.714041|1.641610|1.755098|2.001297|2.136899|3.401820|2.877575|4.953555|3.501587|7.629559|5.514808|9.460221|6.684133|11.391434|16.020343|73.516695| |1.524270|1.595407|0.048193|1.472603|1.502877|1.385439|1.271320|1.252181|1.336715|2.185014|1.746118|3.381478|1.700497|1.517513|1.458744|1.551401|1.747370|1.851962|2.907999|2.405899|4.129187|2.905459|6.043611|4.403135|8.320947|5.135462|11.093364|12.567534|13.896701|36.858105| |1.432596|1.500756|0.045200|1.399014|1.435976|1.334038|1.225434|1.201627|1.274400|2.047268|1.619842|3.110286|1.577792|1.419358|1.367490|1.448491|1.616879|1.705197|2.642027|2.162892|3.740934|2.547216|5.217873|3.625364|6.699377|4.215027|8.153069|8.878876|12.433463|17.615443|0.500000| |1.629873|1.691239|0.051480|1.550091|1.583109|1.449898|1.323736|1.303503|1.397649|2.286259|1.825009|3.585425|1.745574|1.549255|1.472075|1.549728|1.744476|1.878562|2.965807|2.403274|4.020731|2.952295|5.849260|4.240769|8.827579|4.337984|8.048035|7.711897|10.830278|12.340193|0.244572|36.858105| |1.530991|1.564611|0.047196|1.435151|1.456179|1.338956|1.231660|1.218149|1.304358|2.109485|1.677049|3.288734|1.605635|1.438330|1.370362|1.436423|1.601716|1.714830|2.670390|2.131097|3.577328|2.559435|4.935929|3.427655|7.051511|3.466058|6.074078|5.039641|7.391218|7.518716|0.177195|12.662430|36.858105| |1.432049|1.458350|0.043592|1.339415|1.350246|1.246110|1.154831|1.147389|1.227038|1.982794|1.579358|3.075670|1.529991|1.379678|1.325458|1.395879|1.551517|1.641923|2.537529|2.034203|3.458651|2.406061|4.679401|3.204990|6.365880|3.340533|5.867515|4.510614|6.485425|6.579508|0.158231|7.649169|14.452737|36.858105| |1.389295|1.424512|0.042390|1.310043|1.316814|1.217432|1.132233|1.127319|1.204698|1.959965|1.569065|3.032468|1.542098|1.392989|1.350479|1.436624|1.601798|1.675298|2.588448|2.112303|3.652790|2.482776|4.985069|3.435863|6.509776|3.816193|7.029651|5.027248|6.875998|7.235091|0.168705|6.325661|7.612842|12.664543|36.858105| |1.450148|1.506734|0.045060|1.386691|1.400122|1.292366|1.196530|1.187501|1.269278|2.083882|1.674667|3.230513|1.652560|1.483123|1.438918|1.541190|1.733760|1.813639|2.831175|2.358230|4.105204|2.809234|5.890385|4.224853|7.728299|5.119664|11.125130|7.970438|9.559894|12.373688|0.241481|7.383181|6.555544|7.461985|12.414043|36.858105| |1.360507|1.417703|0.042185|1.314457|1.329178|1.234535|1.146925|1.136880|1.209312|1.967032|1.572962|3.003117|1.564184|1.414489|1.381854|1.483459|1.658983|1.716905|2.649621|2.207832|3.907336|2.564484|5.398476|3.722366|6.525111|4.693187|9.461741|6.827117|8.851495|8.908661|0.223990|5.491896|4.993858|5.676062|8.895004|17.513302|0.500000| |1.559480|1.628579|0.048717|1.484366|1.487518|1.363146|1.262457|1.259869|1.355812|2.281746|1.861532|3.604008|1.856207|1.650021|1.605248|1.740843|1.988722|2.076778|3.298106|2.830224|4.951134|3.453510|7.637856|5.801190|10.032312|7.688943|18.778137|8.257708|9.854196|7.972167|0.160910|5.888395|5.001080|5.333691|7.367562|12.535750|0.256437|36.858105| |1.550529|1.609207|0.047784|1.459853|1.449217|1.326702|1.236181|1.242112|1.340605|2.273518|1.867459|3.610337|1.882211|1.677737|1.643054|1.793893|2.052225|2.122193|3.358477|2.893034|5.107571|3.476838|7.591261|5.446750|9.243920|6.682545|11.388738|5.547219|7.514098|5.387509|0.119321|4.534887|4.197844|4.657729|6.311648|7.796727|0.184623|16.024498|73.516695| |17.604415|8.835176|0.216201|5.490677|4.267477|3.332139|3.102672|3.487354|4.606942|9.540467|6.467587|12.730464|4.448076|3.916248|3.071415|2.748597|2.903867|3.591176|4.862231|2.908518|4.454233|2.859974|4.215684|2.213908|4.143636|1.889127|2.385735|1.713974|3.109456|1.602076|0.041544|1.722177|1.622253|1.518528|1.471072|1.530761|0.039682|1.655846|2.941450|0.500000| |17.568147|8.770672|0.173969|6.763715|4.685480|3.771808|3.738078|4.572128|6.574229|9.426221|5.314826|8.780421|4.043246|3.947526|3.105410|2.666226|2.685619|3.178512|4.072642|2.482906|3.933328|2.374824|3.608058|1.890795|3.475950|1.654219|2.093808|1.509516|2.750609|1.413725|0.037019|1.500943|1.418165|1.336260|1.301921|1.354597|0.035467|1.455269|2.584846|0.300722|0.500000| |17.559591|8.829926|0.214490|6.865106|5.382541|4.127814|3.783457|4.203945|5.556755|7.612416|4.605891|8.455680|3.436576|3.171763|2.582424|2.317355|2.405829|2.863167|3.879795|2.424641|3.802880|2.412252|3.679433|1.964016|3.673563|1.709043|2.186538|1.597426|2.925152|1.502377|0.039378|1.617790|1.524915|1.419903|1.367223|1.421564|0.037020|1.514260|2.662541|0.300688|0.300935|0.500000| |4.988060|7.023440|0.229778|8.920187|17.707699|8.930566|5.650070|4.961581|5.656409|6.976238|4.176660|7.219827|3.310034|2.993908|2.508894|2.318493|2.444952|2.885380|3.980521|2.579022|4.104960|2.554951|4.005518|2.122901|3.880284|1.873411|2.373831|1.773434|3.365099|1.625719|0.043086|1.723121|1.572349|1.446377|1.405029|1.500348|0.039412|1.592685|2.740442|0.117476|0.117109|0.143432|0.500000| |3.377204|4.090859|0.114766|5.631000|8.922078|17.716162|8.916786|5.651810|4.961486|4.692397|2.886830|4.859779|2.511224|2.417005|2.121366|1.957268|1.998569|2.238057|3.007086|2.011378|3.322301|1.969575|3.203283|1.712516|3.089585|1.561589|2.000565|1.502639|2.853076|1.391141|0.037397|1.454955|1.340070|1.243369|1.212848|1.290009|0.034294|1.352489|2.327376|0.080872|0.087877|0.098104|0.216000|0.500000| |3.099049|3.535545|0.090995|4.923983|5.641573|8.911708|17.718173|8.903460|5.642746|4.299374|2.604296|4.249181|2.352829|2.391059|2.130164|1.916467|1.890251|2.063562|2.677274|1.780108|2.985691|1.705669|2.781305|1.477532|2.645831|1.359387|1.739698|1.290626|2.419508|1.203120|0.032355|1.248411|1.164423|1.094109|1.073649|1.133267|0.030281|1.190375|2.070636|0.073572|0.086911|0.087825|0.124213|0.214654|0.500000| |3.719964|4.078939|0.096354|5.627518|4.962059|5.653225|8.908212|17.714109|8.930893|5.160594|2.996559|4.716712|2.726026|2.907349|2.544165|2.194293|2.106375|2.296888|2.882154|1.869900|3.128760|1.757391|2.822328|1.483137|2.652738|1.353835|1.720836|1.258534|2.332296|1.174538|0.031360|1.218513|1.144221|1.082830|1.066135|1.119609|0.029855|1.186400|2.086170|0.086110|0.113442|0.100477|0.107666|0.124154|0.214588|0.500000| |6.354905|6.945012|0.140162|8.885608|5.653440|4.960371|5.651138|8.951824|17.700657|8.831427|4.514792|6.758013|3.840971|4.109471|3.300317|2.737071|2.643397|3.005920|3.694636|2.294548|3.747976|2.132451|3.320849|1.724317|3.101200|1.540461|1.939651|1.404014|2.585755|1.304833|0.034471|1.362658|1.278255|1.208491|1.188964|1.248055|0.033027|1.337554|2.366047|0.135511|0.217852|0.151458|0.124101|0.107648|0.124291|0.216544|0.500000| |5.944343|9.011593|0.189532|7.686720|5.429615|4.271722|4.125794|4.900671|6.917418|26.099923|9.455547|10.952639|7.492302|7.375314|4.971796|4.016953|4.012890|4.983584|5.741269|3.311080|5.273836|2.918967|4.379143|2.191771|3.880891|1.916200|2.348452|1.679213|3.107709|1.526632|0.039930|1.582728|1.460158|1.377876|1.369061|1.458830|0.038492|1.594382|2.824218|0.146562|0.162348|0.129264|0.134898|0.098650|0.094553|0.117472|0.199766|0.500000| |4.318166|4.880534|0.114319|4.260735|3.380455|2.932346|2.978071|3.530751|4.400006|10.105654|7.092561|8.881672|8.924881|17.734655|8.984343|5.686474|4.967601|5.628255|5.699704|3.275842|5.392941|2.766252|4.181782|2.071366|3.623207|1.829567|2.231887|1.567126|2.855572|1.432393|0.037373|1.470589|1.372193|1.313885|1.318292|1.395537|0.036975|1.537223|2.768755|0.117791|0.128874|0.096871|0.087017|0.071076|0.072596|0.093327|0.142185|0.243697|0.500000| |2.784827|3.037461|0.076848|2.824252|2.448037|2.239807|2.292163|2.593437|2.929182|5.339275|4.108328|5.970992|5.616279|8.926570|17.732571|8.883391|5.630087|4.916258|4.915580|3.056791|5.417486|2.504019|3.939808|1.935925|3.307827|1.756841|2.129357|1.477380|2.676500|1.348482|0.035289|1.359238|1.272392|1.234170|1.256625|1.332635|0.035684|1.475318|2.684132|0.077588|0.081276|0.066975|0.064495|0.056368|0.058328|0.071066|0.089605|0.121690|0.216424|0.500000| |2.318281|2.535912|0.067642|2.322694|2.105191|1.925157|1.910866|2.069311|2.295593|4.284280|3.559373|5.549223|4.946855|5.675687|8.916094|17.717299|8.983871|5.646844|5.686032|3.788081|7.301290|2.917770|4.688549|2.235512|3.707306|2.049484|2.426224|1.648792|2.969330|1.485709|0.038665|1.472535|1.370057|1.339774|1.386956|1.486108|0.039986|1.675984|3.083284|0.066294|0.064917|0.057047|0.057408|0.049716|0.049151|0.055806|0.067250|0.092293|0.124709|0.213839|0.500000| |2.439336|2.704763|0.075367|2.387537|2.204621|1.969342|1.889903|2.000995|2.247267|4.524890|4.085048|6.770837|5.633333|4.974892|5.645678|8.946365|17.833993|8.934064|9.706682|7.016619|15.152944|4.529301|7.049203|3.123493|5.012628|2.771045|3.140396|2.082939|3.739266|1.832551|0.046952|1.807342|1.654658|1.612542|1.683607|1.834727|0.048945|2.131561|3.941979|0.071557|0.065681|0.060244|0.062085|0.051383|0.048232|0.052680|0.064259|0.092440|0.107927|0.124103|0.217074|0.500000| |3.738030|4.255070|0.129129|3.314706|3.022611|2.510583|2.294754|2.413720|2.855545|7.023087|7.879334|17.860093|7.557282|4.889142|4.073643|4.313252|5.805760|9.424248|25.948544|9.377879|10.807851|7.802571|8.909204|4.032860|7.098906|3.135360|3.622511|2.470227|4.475427|2.171872|0.054687|2.260063|2.037737|1.917516|1.928246|2.093768|0.053936|2.415206|4.339278|0.117048|0.092589|0.090127|0.089267|0.064798|0.056769|0.061049|0.079978|0.123855|0.115438|0.092349|0.098810|0.145700|0.500000| |2.629095|2.800591|0.085176|2.349935|2.246167|1.947895|1.788769|1.838738|2.082255|4.162470|3.829871|8.095146|3.824308|3.034297|2.809983|3.109005|3.976246|4.708902|9.549545|8.886394|11.193232|17.596711|16.527803|7.308318|12.956063|4.760084|5.238679|3.328315|5.735658|2.868728|0.069302|2.975715|2.644164|2.505243|2.566342|2.832350|0.070930|3.491304|6.427858|0.081461|0.066414|0.067380|0.067006|0.051819|0.045386|0.047300|0.057913|0.077207|0.074921|0.067517|0.077607|0.116196|0.204091|0.500000| |2.853284|3.198047|0.101423|2.688460|2.633727|2.249767|2.017146|2.040222|2.312471|4.687615|4.260597|9.042924|4.040980|3.131610|2.825401|3.057901|3.875451|4.806911|9.984342|8.821620|10.777080|17.606057|16.543771|7.222267|12.676941|4.739788|5.200524|3.522930|6.467842|2.928111|0.071775|3.051028|2.607836|2.396907|2.420639|2.735781|0.069065|3.253196|5.640034|0.086363|0.070511|0.073513|0.080759|0.060227|0.050835|0.051685|0.062897|0.086689|0.077874|0.067724|0.075404|0.109540|0.226129|0.302364|0.500000| |1.766101|1.920379|0.057982|1.757701|1.778087|1.621274|1.486283|1.473660|1.587958|2.746948|2.261880|4.305068|2.296048|2.003220|1.952079|2.159131|2.539257|2.653463|4.325666|4.002044|7.281244|4.863461|13.125396|8.968954|11.004229|17.631215|12.553848|7.178375|13.033693|4.651817|0.112092|3.902664|3.103742|2.955185|3.314337|4.383850|0.116938|5.756558|8.874671|0.051451|0.045524|0.047025|0.053297|0.044763|0.038752|0.038235|0.043101|0.053879|0.050921|0.049080|0.057317|0.077020|0.084842|0.117211|0.127034|0.500000| |1.708644|1.823827|0.054378|1.653047|1.643687|1.497308|1.388576|1.393549|1.508724|2.632584|2.193806|4.191887|2.262050|1.984561|1.956339|2.190215|2.584279|2.649842|4.307086|4.035010|7.488590|4.870616|13.158696|8.966979|10.980360|17.636276|12.557230|5.725727|8.847359|4.337932|0.101731|3.684832|3.118808|3.119630|3.660747|4.715866|0.124523|7.256044|13.143757|0.050336|0.044377|0.045264|0.048701|0.040977|0.036198|0.036397|0.041441|0.051465|0.050224|0.049226|0.058656|0.079903|0.083692|0.127021|0.116976|0.301349|0.500000| |1.784982|1.854462|0.056848|1.679063|1.707161|1.547694|1.407924|1.391196|1.503444|2.511477|2.026876|4.036229|1.927423|1.690554|1.596208|1.683086|1.914214|2.085423|3.352460|2.730926|4.486576|3.478386|6.853217|5.185584|11.823139|4.901761|8.709765|7.590221|10.889856|8.771409|0.175048|17.518201|8.975483|6.264670|5.460169|6.358846|0.132947|6.082247|8.559625|0.052798|0.045371|0.049023|0.051837|0.042934|0.036677|0.035999|0.040754|0.047946|0.044406|0.040680|0.044130|0.055040|0.071630|0.098394|0.100732|0.118619|0.112753|0.500000| |1.633257|1.700990|0.052009|1.570649|1.620102|1.488415|1.351809|1.321933|1.411571|2.277298|1.799708|3.525336|1.707351|1.518523|1.437021|1.502740|1.682822|1.819227|2.853641|2.284134|3.813056|2.769379|5.390763|3.776123|7.734078|3.812290|6.613051|6.617793|10.752358|8.860294|0.225471|17.572741|8.889678|5.757881|4.805697|5.474662|0.125352|4.559433|6.504225|0.047615|0.041668|0.045334|0.049253|0.041755|0.035470|0.034246|0.038013|0.043844|0.040233|0.036933|0.039598|0.048097|0.060667|0.076399|0.081232|0.099775|0.089906|0.305098|0.500000| |1.541907|1.564478|0.047238|1.436684|1.460404|1.343506|1.234563|1.219408|1.304792|2.089030|1.650072|3.243643|1.565368|1.405442|1.332551|1.386036|1.537220|1.653880|2.560679|2.011249|3.353454|2.395324|4.501402|3.045795|6.307601|2.991308|4.968581|4.092023|6.368915|5.467447|0.138429|8.627003|17.690879|9.188305|5.488075|4.783446|0.108542|3.941771|6.142172|0.045370|0.039614|0.042961|0.043852|0.037395|0.032431|0.031802|0.035482|0.040066|0.037460|0.034448|0.036641|0.043771|0.054724|0.069013|0.068607|0.075697|0.075278|0.198307|0.216114|0.500000| |1.371785|1.385975|0.041224|1.275259|1.282196|1.186592|1.104069|1.099014|1.173596|1.879765|1.491074|2.896902|1.443785|1.309922|1.259692|1.321249|1.458481|1.539482|2.356999|1.868412|3.179514|2.177297|4.159401|2.771994|5.467195|2.846204|4.763567|3.594256|5.380963|4.811117|0.122467|5.500896|9.190540|17.684369|8.668779|5.413471|0.125362|4.235755|6.989316|0.040413|0.035687|0.037878|0.037995|0.032857|0.029104|0.028890|0.032184|0.036302|0.034786|0.032708|0.035294|0.041960|0.049539|0.063417|0.060176|0.070754|0.075247|0.133494|0.126643|0.222305|0.500000| |1.401852|1.431140|0.042418|1.309572|1.307014|1.205613|1.125271|1.126295|1.207462|1.980433|1.594756|3.085551|1.576197|1.424217|1.384984|1.478810|1.651498|1.720582|2.658857|2.174643|3.767479|2.550061|5.100032|3.480518|6.562036|3.804395|6.665244|4.397601|6.144881|5.549300|0.129299|5.110706|5.971035|8.928230|17.549620|8.872353|0.194310|7.357587|13.209745|0.041428|0.036584|0.038163|0.038591|0.033213|0.029599|0.029639|0.033252|0.038384|0.037348|0.035773|0.039721|0.048399|0.054868|0.074445|0.067940|0.089849|0.105107|0.134272|0.111110|0.129721|0.207481|0.500000| 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